In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2009 | 26 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.54 | 12.78 | -35.04 | 1 | 4 | 1 | 40 | 360.518 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 10.44 | -5.25 | 0 | 4 | 0 | 39 | 359.51 | 8 | ↓ |